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Kondakova Olga Anatol'evna

Publications in Math-Net.Ru

  1. Influence of the method of hydrogen atoms incorporation into the target protein on the protein-ligand binding energy

    Vestnik YuUrGU. Ser. Mat. Model. Progr., 10:3 (2017),  94–107
  2. An algorithm of high performance modeling of optical nanocoating deposition processes

    Num. Meth. Prog., 14:3 (2013),  323–327
  3. High performance modeling of modern deposition processes for optical coating nanotechnology

    Num. Meth. Prog., 13:4 (2012),  491–496
  4. Quantum chemical estimation of the fluoroacidity as a method to determine the conditions of subvalent bismuth stabilization in fluoride glasses

    Num. Meth. Prog., 13:2 (2012),  347–351
  5. Calculation of excited states of the polycation Bi$_5^3+$ by the spin-orbit configuration interaction method

    Num. Meth. Prog., 12:4 (2011),  443–449
  6. Quantum-chemical modeling of excited states of Bismuth monocations

    Num. Meth. Prog., 12:4 (2011),  417–422
  7. Implementation of parallel computing for docking programs SOLGRID and SOL

    Num. Meth. Prog., 12:1 (2011),  9–23
  8. An algorithm of assigning the force parameters to atoms of organic molecules and proteins in the framework of the MMFF94 force field

    Num. Meth. Prog., 7:4 (2006),  128–136


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